4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-hydroxy-7-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-hydroxy-7-methyl-2H-1-benzopyran-2-one
4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-hydroxy-7-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-4039 |
| Compound Name: | 4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-hydroxy-7-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 368.41 |
| Molecular Formula: | C21 H21 F N2 O3 |
| Smiles: | Cc1cc2c(cc1O)C(CN1CCN(CC1)c1ccccc1F)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 2.9871 |
| logD: | 2.9845 |
| logSw: | -3.2232 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.886 |
| InChI Key: | NBWICSUSZDDHLQ-UHFFFAOYSA-N |